N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-naphthalen-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-naphthalen-2-ylsulfanyl-ethanamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(2-naphthylsulfanyl)acetamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-(2-naphthalenylthio)acetamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-naphthalen-2-ylsulfanylacetamide Traditional Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-(2-naphthylthio)acetamide Formula: C22H24N3O2S+ MolecularWeight: 394.50986

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H23N3O2S/c26-22(16-28-20-7-6-18-3-1-2-4-19(18)13-20)24-15-17-5-8-21(23-14-17)25-9-11-27-12-10-25/h1-8,13-14H,9-12,15-16H2,(H,24,26)/p+1